3-(4-bromophenyl)-1-tert-butyl-pyrazole-4-carbaldehyde

Systemtic Name: 3-(4-bromophenyl)-1-tert-butyl-pyrazole-4-carbaldehyde Openeye Name: 3-(4-bromophenyl)-1-tert-butyl-pyrazole-4-carbaldehyde CAS Name: 3-(4-bromophenyl)-1-tert-butyl-4-pyrazolecarboxaldehyde IUPAC Name: 3-(4-bromophenyl)-1-tert-butylpyrazole-4-carbaldehyde Traditional Name: 3-(4-bromophenyl)-1-tert-butyl-pyrazole-4-carbaldehyde Formula: C14H15BrN2O MolecularWeight: 307.1857

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C(=N1)C2=CC=C(C=C2)Br)C=O

Isomeric SMILES

CC(C)(C)N1C=C(C(=N1)C2=CC=C(C=C2)Br)C=O

InChI

InChI=1S/C14H15BrN2O/c1-14(2,3)17-8-11(9-18)13(16-17)10-4-6-12(15)7-5-10/h4-9H,1-3H3